SCHEMBL6625751

SCHEMBL6625751

Cc1cc2cc(Nc3ccnc4cc(C(=O)N5CC[C@@H](N(C)C)C5)sc34)ccc2[nH]1

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EGFR P00533 8/20 0.49
FLT1 P17948 8/20 0.49
KDR P35968 3/20 0.48
MET P08581 2/20 0.48
SYK P43405 2/20 0.46
MKNK1 Q9BUB5 6/20 0.40
PIK3CA P42336 1/20 0.37
IKBKB O14920 1/20 0.37
CHUK O15111 1/20 0.37
IKBKG Q9Y6K9 1/20 0.37

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6302480 1.00 EGFR (0.49) EGFRFLT1KDRMETSYK
SCHEMBL6302469 1.00 EGFR (0.49) EGFRFLT1KDRMETSYK
SCHEMBL6625595 0.94 EGFR (0.51) EGFRFLT1KDRMETSYK
SCHEMBL6302347 0.94 EGFR (0.47) EGFRFLT1KDRMETSYK
SCHEMBL6302403 0.91 FLT1 (0.51) EGFRFLT1KDRMETSYK
SCHEMBL6302384 0.91 FLT1 (0.51) EGFRFLT1KDRMETSYK
SCHEMBL6309330 0.91 FLT1 (0.51) EGFRFLT1KDRMETSYK
SCHEMBL6301857 0.91 FLT1 (0.49) EGFRFLT1KDRMETSYK
SCHEMBL6301850 0.91 FLT1 (0.49) EGFRFLT1KDRMETSYK
SCHEMBL6305275 0.91 FLT1 (0.49) EGFRFLT1KDRMETSYK

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1287001-B1 THIOPHENE DERIVATIVES USEFUL AS ANTICANCER AGENTS PFIZER PROD INC (US) 2004-09-29 EP disclosed